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1-[2-chloro-4-(4-chlorophenoxy)phenyl]ethanone

1-[2-chloro-4-(4-chlorophenoxy)phenyl]ethanone

CAS: 119851-28-4

Formula: C14H10Cl2O2

SMILES: CC(=O)C1=C(Cl)C=C(OC2=CC=C(Cl)C=C2)C=C1

IUPAC: 1-[2-chloro-4-(4-chlorophenoxy)phenyl]ethan-1-one

InChI: InChI=1S/C14H10Cl2O2/c1-9(17)13-7-6-12(8-14(13)16)18-11-4-2-10(15)3-5-11/h2-8H,1H3

Composition: C (59.81%), H (3.59%), Cl (25.22%), O (11.38%)

Molar Mass: 281.13

Atom Count: 28

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 280.005785
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey BDTJIVUVQRVLLJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.31
Topological Polar Surface Area 26.3
Polarizability 28.15
Ring Count 2
Rotatable Bond Count 3

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